(2S)-N-[(6R)-3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-phenyl-2-phenylsulfanyl-ethanamide

Systemtic Name: (2S)-N-[(6R)-3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-phenyl-2-phenylsulfanyl-ethanamide Openeye Name: (2S)-N-[(6R)-3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-phenyl-2-phenylsulfanyl-acetamide CAS Name: (2S)-N-[(6R)-3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-phenyl-2-(phenylthio)acetamide IUPAC Name: (2S)-N-[(6R)-3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-phenyl-2-phenylsulfanylacetamide Traditional Name: (2S)-N-[(6R)-3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-phenyl-2-(phenylthio)acetamide Formula: C24H22N2OS2 MolecularWeight: 418.57428

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)C(C3=CC=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

C[C@@H]1CCC2=C(C1)SC(=C2C#N)NC(=O)[C@H](C3=CC=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C24H22N2OS2/c1-16-12-13-19-20(15-25)24(29-21(19)14-16)26-23(27)22(17-8-4-2-5-9-17)28-18-10-6-3-7-11-18/h2-11,16,22H,12-14H2,1H3,(H,26,27)/t16-,22+/m1/s1